Vitas-M small molecule compound

1-methyl-8-phenyl-9-(2-phenylethyl)-3,9-dihydro-1H-purine-2,6-dione

Catalog ID
STK169394
SMILES O=c1[nH]c2n(CCc3ccccc3)c(nc2c(=O)n1C)c1ccccc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C20H18N4O2 MW 346.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O2/c1-23-19(25)16-18(22-20(23)26)24(13-12-14-8-4-2-5-9-14)17(21-16)15-10-6-3-7-11-15/h2-11H,12-13H2,1H3,(H,22,26)
InChIKey
FVINWUNQVCGHIB-UHFFFAOYSA-N
Synonyms
61080-56-6
1HPURINE26DIONE39DIHYDRO1METHYL8PHENYL9(2PHENYLETHYL)
1METHYL8PHENYL9(2PHENYLETHYL)13DIHYDROPURINE26DIONE
1METHYL8PHENYL9(2PHENYLETHYL)39DIHYDRO1HPURINE26DIONE
1methyl8phenyl9(2phenylethyl)3Hpurine26dione
1methyl9phenethyl8phenyl1Hpurine26(3H9H)dione
1METHYL9PHENETHYL8PHENYL39DIHYDROPURINE26DIONE
1METHYL9PHENETHYL8PHENYL3HPURINE26DIONE
61080566
CN1C(=O)C2=C(NC1=O)N(C(=N2)C3=CC=CC=C3)CCC4=CC=CC=C4
InChI=1SC20H18N4O2c12319(25)1618(2220(23)26)24(1312148425914)17(2116)15106371115h211H1213H21H3(H2226)
MFCD01166614
O=c1(nH)c2n(CCc3ccccc3)c(nc2c(=O)n1C)c1ccccc1
ZINC000003984899
ZINC3984899

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.